Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR4 | Q13639 | 8/20 | 0.49 |
| ▸ | HTR2C | P28335 | 3/20 | 0.46 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.46 |
| ▸ | HTR1D | P28221 | 2/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.46 |
| ▸ | HTR2B | P41595 | 2/20 | 0.46 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.46 |
| ▸ | HTR3A | P46098 | 2/20 | 0.46 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.46 |
| ▸ | HTR3B | O95264 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.46 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9280925 | 0.73 | HTR4 (0.52) | HTR4HTR2CADRA2CHTR1DADRA1A | |
| SCHEMBL14905735 | 0.72 | HTR4 (0.72) | HTR4HTR2CADRA2CHTR1DADRA1A | |
| SCHEMBL7348157 | 0.71 | HTR4 (0.41) | HTR4ADRA1AADRA2BADRA1BADRA2A | |
| SCHEMBL7391969 | 0.66 | HTR4 (0.78) | HTR4HTR2CADRA2CHTR1DADRA1A | |
| SCHEMBL13439990 | 0.66 | HTR4 (0.76) | HTR4HTR2CADRA2CHTR1DADRA1A | |
| SCHEMBL9341467 | 0.66 | HTR4 (0.71) | HTR4CYP1A2CYP2C9PMP22NPSR1 | |
| SCHEMBL13036127 | 0.65 | HTR4 (0.80) | HTR4CYP1A2CYP2D6CYP2C9PMP22 | |
| SCHEMBL7323178 | 0.65 | HTR4 (0.72) | HTR4HTR2CADRA2CHTR1DADRA1A | |
| SCHEMBL9342314 | 0.65 | HTR4 (0.58) | HTR4CYP1A2CYP2C9PMP22NPSR1 | |
| SCHEMBL7328044 | 0.65 | HTR4 (0.56) | HTR4HTR2CADRA2CHTR1DADRA1A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5726187-A | N-alkylpiperidinyl-4-methyl carboxylic esters/amides of condensed ring systems as 5-HT4 receptor antagonists | SMITHKLINE BEECHAM PLC (GB) | 1998-03-10 | — | — | US | disclosed |